Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.82 |
| ▸ | MAPT | P10636 | 3/20 | 0.82 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.82 |
| ▸ | PDE4A | P27815 | 7/20 | 0.57 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.57 |
| ▸ | PDE4C | Q08493 | 7/20 | 0.57 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.50 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1009382 | 1.00 | GAA (0.82) | GAAMAPTKDM4EPDE4APDE4B | |
| SCHEMBL1159205 | 0.92 | GAA (0.96) | GAAMAPTKDM4EPDE4APDE4B | |
| SCHEMBL18074050 | 0.91 | GAA (0.70) | GAAMAPTKDM4EPDE4APDE4B | |
| SCHEMBL31095359 | 0.90 | MAPT (0.78) | GAAMAPTKDM4EPDE4APDE4B | |
| SCHEMBL112468 | 0.90 | MAPT (0.78) | GAAMAPTKDM4EPDE4APDE4B | |
| SCHEMBL8416240 | 0.89 | MAPT (0.77) | GAAMAPTKDM4EPDE4APDE4B | |
| Hydrochloric Acid SCHEMBL4945295 | 0.88 | MAPT (0.81) | GAAMAPTKDM4EPDE4APDE4B | |
| SCHEMBL27547295 | 0.86 | MAPT (0.67) | GAAMAPTKDM4EPDE4APDE4B | |
| SCHEMBL22502189 | 0.85 | MAPT (0.66) | GAAMAPTKDM4EPDE4APDE4B | |
| SCHEMBL13984178 | 0.83 | MAPT (0.69) | GAAMAPTKDM4EPDE4APDE4B |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113563244-B | Substituted aza five-membered ring compound and application thereof in medicine | 广东东阳光药业股份有限公司 | 2025-01-10 | — | — | CN | disclosed |
| CN-113563245-B | Substituted pyrrolidines and their use in medicine | 广东东阳光药业股份有限公司 | 2024-10-15 | — | — | CN | disclosed |